Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 17/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1105750 | 0.90 | CCR5 (0.40) | CCR5KCNH2GPR119ESR1ESR2 | |
| SCHEMBL3576540 | 0.89 | CCR5 (0.39) | CCR5KCNH2 | |
| SCHEMBL1095663 | 0.88 | CCR5 (0.40) | CCR5KCNH2 | |
| SCHEMBL1097652 | 0.86 | CCR5 (0.38) | CCR5KCNH2GPR119 | |
| SCHEMBL1096057 | 0.85 | CCR5 (0.38) | CCR5GPR119 | |
| SCHEMBL1096778 | 0.84 | CCR5 (0.39) | CCR5KCNH2 | |
| SCHEMBL1096420 | 0.84 | CCR5 (0.36) | CCR5GPR119ESR1ESR2 | |
| SCHEMBL1097046 | 0.83 | CCR5 (0.37) | CCR5KCNH2 | |
| SCHEMBL1096488 | 0.83 | CCR5 (0.39) | CCR5ESR1ESR2 | |
| SCHEMBL1096227 | 0.83 | CCR5 (0.36) | CCR5GPR119 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8153658-B2 | Piperidine derivative or salt thereof | ASTELLAS PHARMA, INC. (JP) | 2012-04-10 | — | — | US | disclosed |